Basic information
- CAS
4417-72-5- Standard SMILES
C=CCNc1nc(Cl)nc(OCC=C)n1- InChIKey
OBYURHSXKYQFNC-UHFFFAOYSA-N- Molecular formula
- C9H11ClN4O
- Average molar mass
- 226.66 g/mol
- Monoisotopic mass
- 226.0621387
Names & identifiers
- Preferred name
- 4-chloro-6-prop-2-enoxy-N-prop-2-enyl-1,3,5-triazin-2-amine
- IUPAC
- 4-chloro-6-prop-2-enoxy-N-prop-2-enyl-1,3,5-triazin-2-amine
Names & synonyms
4-chloro-6-prop-2-enoxy-N-prop-2-enyl-1,3,5-triazin-2-amine4417-72-5DTXSID302746714-Chloro-N-(prop-2-en-1-yl)-6-[(prop-2-en-1-yl)oxy]-1,3,5-triazin-2-amine
Database identifiers
- CAS
4417-72-5- PubChem CID
- 20463
- DTXSID
DTXSID30274671- Nikkaji
- J1.554.063J
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 59.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 214
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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